P018-0671 Screening compound: N-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)-2,3-dimethoxybenzamide

P018-0671 Screening compound: N-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)-2,3-dimethoxybenzamide
P018-0671 Screening compound: N-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)-2,3-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P018-0671
N-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)-2,3-dimethoxybenzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

P018-0671

Molecular Formula

C22H18FN3O4S (C22 H18 FN3 O4 S)

Compound Name

N-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)-2,3-dimethoxybenzamide

IUPAC name

N-({5-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]thiophen-2-yl}methyl)-23-dimethoxybenzamide

SMILES

COc1cccc(C(NCc2ccc(-c3nc(-c(cc4)ccc4F)no3)s2)=O)c1OC

InChI

InChI=1S/C22H18FN3O4S/c1-28-17-5-3-4-16(19(17)29-2)21(27)24-12-15-10-11-18(31-15)22-25-20(26-30-22)13-6-8-14(23)9-7-13/h3-11H,12H2,1-2H3,(H,24,27)

InChI Key

QUZBMMNTJSYUOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27558690

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.241

Distribution Coefficient, logD

5.241

Water Solubility, LogSw

-5.05

Polar Surface Area

72.423

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

-4.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with P018-0671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P018-0671?
Check Price and Availability of P018-0671, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of P018-0671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P018-0671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P018-0671
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of P018-0671 available by request